NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3083 8.2893 120.3160 55.3778 33.6995 174.3176 2 T 4.3126 7.8667 112.9413 60.2139 71.0079 171.7576 3 Y 5.2492 8.7356 121.3469 56.5201 41.7255 175.9603 4 G 4.3936 9.1971 108.2924 45.1761 0.0000 171.0237 5 I 5.3544 8.9283 120.5472 59.3581 40.3201 175.2827 6 V 4.9776 9.1281 126.2174 61.1886 34.6896 173.9789 7 I 5.1202 8.8081 128.4124 59.5847 40.0094 174.6314 8 V 4.9455 8.9934 126.5425 61.2275 34.3061 174.2512 9 S 5.5406 8.9442 121.3942 55.5873 66.0347 174.2055 10 H 4.5452 9.9639 120.4655 57.4686 29.8264 175.2363 11 S 4.9093 7.9562 113.8473 55.1543 64.4895 172.8333 12 P 4.3768 0.0000 0.0000 66.1430 30.9439 178.5378 13 E 3.9732 8.1120 117.8804 59.0268 29.3607 179.1026 14 I 3.6746 7.7085 119.2469 64.3359 37.2170 178.2513 15 A 3.9979 7.9359 121.4914 55.2046 18.2442 179.6085 16 S 4.1319 8.3310 111.7841 61.6149 62.4651 176.6993 17 G 3.6017 8.3965 108.7604 47.5972 0.0000 175.4707 18 L 3.9701 8.2674 123.0253 57.7223 42.0354 178.8703 19 K 3.9035 8.2176 119.6534 59.5994 31.9865 178.9356 20 K 3.9784 8.0591 118.6540 59.1821 31.7182 179.0459 21 L 4.0023 7.9434 119.8550 58.3182 42.3319 178.8281 22 I 3.7982 8.0551 119.7765 64.5661 36.6873 178.6982 23 R 4.1246 8.3003 118.8398 59.1632 29.5910 178.8343 24 E 4.1840 7.9518 117.4775 58.2346 29.4981 177.8184 25 V 4.3446 7.8169 109.0935 60.8876 33.3500 176.1836 26 A 4.8091 7.2775 121.0055 50.5435 18.8322 175.8896 27 K 4.1753 8.2220 120.3528 57.8226 32.9995 178.1792 28 N 4.6758 8.2614 115.1353 53.8831 39.3695 175.7419 29 I 3.8837 7.5783 110.7676 60.5292 38.4676 175.8030 30 S 4.4675 8.4843 118.0763 58.1746 63.5185 172.9802 31 L 5.3805 8.4459 126.8586 53.4436 44.7594 175.4830 32 T 4.9388 9.0597 115.2561 60.0940 72.5234 172.6069 33 A 5.2231 8.3958 122.8912 50.8713 22.5455 175.3459 34 I 4.6163 8.8646 120.3065 59.7220 41.9502 173.9556 35 G 4.7755 8.3647 114.2830 45.6996 0.0000 173.5602 36 G 4.2049 8.6498 111.5410 44.1474 0.0000 172.7003 37 L 4.4878 8.2964 119.3152 52.9545 43.0552 177.8248 38 E 3.9192 8.6698 120.3724 59.1778 29.5369 176.8894 39 N 4.6581 8.1877 114.1302 52.5190 37.4335 175.9911 40 G 3.9041 8.2049 106.8645 45.7701 0.0000 173.9628 41 E 4.2348 8.3466 120.9146 55.1830 30.4277 175.8017 42 I 4.1957 8.4299 124.5841 60.1835 37.7862 177.1041 43 G 4.0861 7.1558 112.3266 44.8752 0.0000 171.1521 44 T 4.9264 7.6364 108.7322 59.1132 72.0492 173.6138 45 S 4.7744 8.0795 115.9816 55.5399 67.5416 174.5706 46 F 4.0050 8.8330 124.9525 61.9356 39.1757 177.2775 47 D 4.4335 8.2925 117.7564 57.5398 40.7161 178.9140 48 R 3.9872 8.1002 118.5599 58.8261 30.0921 179.1920 49 V 3.4825 7.7862 118.2426 66.1420 31.4544 177.5939 50 M 3.7598 7.9890 118.2954 58.8498 31.8500 178.0100 51 N 4.3115 8.2257 116.2471 56.1306 38.4679 177.3279 52 A 3.9814 7.7323 121.4337 54.9565 18.5586 179.6035 53 I 3.7969 7.7248 118.4254 64.7756 37.0532 178.6086 54 E 4.0190 8.2534 118.1664 59.0537 29.3190 178.7003 55 E 4.0499 8.2262 119.1317 57.8103 29.9724 176.7360 56 N 4.5290 7.3610 117.9004 53.0598 39.4837 174.9246 57 E 4.0108 8.8047 124.6484 58.6879 29.9325 177.1983 58 A 4.3879 8.0476 121.1368 51.7848 19.7106 176.6373 59 D 4.7218 8.0800 116.6973 54.3723 43.0774 175.9429 60 N 5.3002 7.9993 116.2033 51.4169 41.2272 173.4747 61 L 5.2327 8.8811 125.2395 52.7697 44.6452 175.9952 62 L 4.9714 9.2420 125.6280 54.5599 43.0291 176.0835 63 T 5.1411 8.8596 121.2270 61.7341 71.8005 173.3863 64 F 5.4875 9.2949 123.5474 55.9981 43.4376 173.7594 65 F 5.7734 8.7520 114.9392 56.5890 40.4449 172.2685 66 D 4.4946 9.3314 118.5726 53.6314 39.4772 176.0116 67 L 4.7509 7.4768 116.4415 51.4958 44.2939 177.9369 68 G 4.3508 8.9420 109.9601 47.4778 0.0000 176.0163 69 S 4.2819 8.3212 114.1079 60.5234 63.2391 175.4814 70 A 4.2146 8.6215 124.6329 53.8436 18.4346 179.2348 71 R 3.1466 7.7154 117.9015 59.1510 29.9642 177.9794 72 M 3.9221 7.9616 117.6211 59.0570 32.1397 177.9409 73 N 4.4092 8.0551 115.7326 56.2347 38.6366 177.3120 74 L 3.8931 7.5878 120.6748 57.7921 41.7600 179.2638 75 D 4.3086 8.2662 119.1019 57.1111 40.4814 178.8051 76 L 4.3408 7.9167 120.3781 57.3499 41.8921 179.3836 77 V 3.6889 8.0678 118.3974 65.9370 31.1909 177.7647 78 S 4.0334 8.1264 112.3233 61.7090 62.3520 175.9562 79 E 4.1989 8.3114 120.3071 58.4730 28.8262 178.1409 80 M 4.7989 7.9537 116.8064 54.8800 32.9231 175.0005 81 T 4.6627 7.6656 112.3428 60.3093 70.0424 173.7455 82 D 4.5493 8.4626 124.4121 55.5334 41.4353 177.1593 83 K 4.2808 7.8333 118.7278 56.3212 33.3074 176.8061 84 E 4.4430 9.0710 122.5032 55.0034 30.5912 175.2493 85 L 4.7892 8.3377 124.9906 54.1297 43.3041 176.7599 86 T 4.3312 8.9083 120.3231 61.8835 70.9268 173.1141 87 I 4.5087 8.0176 127.9085 60.0255 38.4435 175.3112 88 F 4.6508 8.5706 126.2445 55.5174 40.6460 176.9052 89 N 4.8304 8.6187 123.2245 52.2917 36.6320 173.9528 90 V 5.0061 7.3263 112.6326 58.2726 36.7210 174.6896 91 P 4.2211 0.0000 0.0000 62.7939 31.9752 177.3148 92 L 3.9641 8.5043 124.5217 58.5721 42.6104 179.2377 93 I 3.6786 7.7493 118.6955 64.5975 37.2113 178.3119 94 E 4.0161 8.0950 119.0211 59.1441 29.2710 179.6731 95 G 3.4323 8.2398 105.6605 47.7596 0.0000 175.7820 96 A 2.5800 7.5811 123.8153 54.1780 18.1963 179.1217 97 Y 3.7243 8.0560 118.2318 61.0508 38.9230 178.3807 98 T 3.7912 7.9439 116.3799 66.5806 68.4938 176.4786 99 A 3.8918 7.8594 122.7012 55.2119 18.2855 179.8847 100 S 3.9539 8.0130 113.4743 61.6554 62.8891 176.8351 101 A 3.7955 7.8340 123.5438 54.9524 18.0127 179.6923 102 L 3.8492 7.8217 117.5013 57.7742 41.7225 179.4623 103 L 3.8935 8.1319 120.5971 58.1707 41.8238 178.4829 104 E 3.9079 8.2000 118.0697 59.3015 29.6507 178.2225 105 A 4.2194 7.6936 118.4769 53.0467 18.5095 178.1714 106 G 3.8321 7.8145 105.3687 45.0299 0.0000 173.8926 107 A 4.0844 7.7199 122.1683 51.8999 19.0319 179.0426 108 T 4.2354 8.1259 111.2707 60.9863 71.1908 175.7131 109 F 3.9567 8.4977 122.9192 61.5049 39.3627 176.8870 110 E 3.7250 8.2410 117.4407 59.2795 29.3992 179.0924 111 A 3.9365 7.8062 120.3168 55.1117 18.3571 179.8140 112 I 3.5209 7.6886 118.3455 64.3233 37.1111 178.5371 113 K 3.7318 7.8979 120.8736 59.3988 31.6980 178.3553 114 E 3.8845 7.8609 118.5957 59.4030 29.8467 178.5824 115 Q 4.0963 7.9143 117.7493 58.8801 28.7242 178.5749 116 L 4.0008 8.1832 120.3317 57.5370 41.0613 179.2091 117 E 4.0044 8.5512 119.1968 59.3459 29.1579 179.1658 118 K 4.2079 7.8428 116.3956 58.1759 32.1712 177.4774 119 M 4.5841 7.6784 117.4861 54.6130 32.7217 175.8726 120 L 4.5426 7.5499 119.8127 55.0597 42.1278 176.5491 121 I 4.7581 8.5385 116.2080 58.7179 41.3184 174.4167 122 E 4.0297 8.8017 124.2670 55.9795 29.9477 177.6112 123 K 4.4944 8.5233 128.3324 55.0758 31.3081 176.4272 124 R 4.1528 7.8001 120.5622 57.5408 31.3042 176.9858 125 S 4.2819 7.8418 112.6292 58.4347 63.7377 172.7327 126 H 5.1202 8.2384 118.5523 54.3604 32.4288 172.2320 127 H 4.6736 8.6828 122.3790 55.1614 31.0315 174.9148 128 H 4.5051 8.2658 121.7568 55.9554 28.8649 174.4504 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.29 4.31 0.00 1.61 1.93 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 2 T 7.87 4.31 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 3 Y 8.74 5.25 0.00 2.90 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 9.20 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.93 5.35 1.95 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.03 1.07 0.00 0.00 6 V 9.13 4.98 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.98 0.00 0.00 7 I 8.81 5.12 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.75 0.98 0.00 0.00 8 V 8.99 4.95 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.97 0.00 0.00 9 S 8.94 5.54 0.00 3.95 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 H 9.96 4.55 0.00 3.16 3.29 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 7.96 4.91 0.00 3.85 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.38 0.00 2.31 2.39 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 13 E 8.11 3.97 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 14 I 7.71 3.67 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.70 0.93 0.00 0.00 15 A 7.94 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.33 4.13 0.00 3.98 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.40 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.27 3.97 0.00 1.83 1.76 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.22 3.90 0.00 2.00 1.95 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 20 K 8.06 3.98 0.00 2.03 1.85 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.64 7.81 21 L 7.94 4.00 0.00 1.74 1.95 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.06 3.80 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.71 0.81 0.00 0.00 23 R 8.30 4.12 0.00 1.97 1.99 0.00 3.29 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.83 0.00 24 E 7.95 4.18 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 25 V 7.82 4.34 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.67 0.00 0.00 26 A 7.28 4.81 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.22 4.18 0.00 1.75 1.87 0.00 1.89 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.40 7.81 28 N 8.26 4.68 0.00 2.86 2.87 0.00 0.00 7.01 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 I 7.58 3.88 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.52 0.99 0.00 0.00 30 S 8.48 4.47 0.00 3.85 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.45 5.38 0.00 1.59 1.50 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 32 T 9.06 4.94 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 33 A 8.40 5.22 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.86 4.62 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.37 0.96 0.00 0.00 35 G 8.36 4.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.65 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.30 4.49 0.00 1.87 1.62 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.67 3.92 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 39 N 8.19 4.66 0.00 2.88 2.90 0.00 0.00 6.12 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.20 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.35 4.23 0.00 2.16 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 42 I 8.43 4.20 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.94 0.77 0.00 0.00 43 G 7.16 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.64 4.93 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 45 S 8.08 4.77 0.00 4.05 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.83 4.01 0.00 3.14 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.29 4.43 0.00 2.79 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.10 3.99 0.00 1.86 1.95 0.00 3.31 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 49 V 7.79 3.48 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.93 0.00 0.00 50 M 7.99 3.76 0.00 1.98 1.34 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 51 N 8.23 4.31 0.00 2.91 2.83 0.00 0.00 6.91 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.73 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.72 3.80 1.92 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.50 0.86 0.00 0.00 54 E 8.25 4.02 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 55 E 8.23 4.05 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 56 N 7.36 4.53 0.00 2.84 2.80 0.00 0.00 7.30 8.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.80 4.01 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 58 A 8.05 4.39 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 8.08 4.72 0.00 2.53 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.00 5.30 0.00 2.13 2.49 0.00 0.00 6.46 6.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.88 5.23 0.00 1.55 1.60 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 62 L 9.24 4.97 0.00 1.97 1.92 1.26 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.86 5.14 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 64 F 9.29 5.49 0.00 3.03 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 8.75 5.77 0.00 3.05 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 D 9.33 4.49 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.48 4.75 0.00 1.73 1.81 0.76 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.94 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.32 4.28 0.00 4.12 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.62 4.21 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.72 3.15 0.00 1.61 1.94 0.00 2.64 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 72 M 7.96 3.92 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.65 0.00 73 N 8.06 4.41 0.00 2.77 2.84 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.59 3.89 0.00 1.54 1.56 0.67 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.27 4.31 0.00 2.80 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.92 4.34 0.00 2.04 1.99 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.07 3.69 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.34 0.00 0.00 78 S 8.13 4.03 0.00 3.91 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.31 4.20 0.00 2.30 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 80 M 7.95 4.80 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.50 0.00 81 T 7.67 4.66 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 82 D 8.46 4.55 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.83 4.28 0.00 1.61 1.70 0.00 1.65 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.39 7.81 84 E 9.07 4.44 0.00 1.88 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 85 L 8.34 4.79 0.00 1.45 1.53 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.91 4.33 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 87 I 8.02 4.51 1.77 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.41 0.95 0.00 0.00 88 F 8.57 4.65 0.00 2.68 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.62 4.83 0.00 2.73 2.99 0.00 0.00 6.98 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.33 5.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.20 0.00 0.00 91 P 0.00 4.22 0.00 2.19 1.98 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 92 L 8.50 3.96 0.00 1.81 1.65 1.07 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.75 3.68 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.46 0.82 0.00 0.00 94 E 8.09 4.02 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 95 G 8.24 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.58 2.58 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.06 3.72 0.00 3.08 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.94 3.79 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 99 A 7.86 3.89 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.01 3.95 0.00 3.77 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.83 3.80 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.82 3.85 0.00 1.79 1.66 0.84 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.13 3.89 0.00 1.83 1.81 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.20 3.91 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 105 A 7.69 4.22 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.81 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.72 4.08 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.13 4.24 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 109 F 8.50 3.96 0.00 2.28 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.24 3.72 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 111 A 7.81 3.94 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 I 7.69 3.52 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.76 0.77 0.00 0.00 113 K 7.90 3.73 0.00 1.26 1.66 0.00 1.53 0.00 0.00 1.44 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.51 7.81 114 E 7.86 3.88 0.00 1.95 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 115 Q 7.91 4.10 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.55 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 116 L 8.18 4.00 0.00 1.41 1.51 -0.09 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.55 4.00 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 118 K 7.84 4.21 0.00 1.86 1.86 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.66 7.81 119 M 7.68 4.58 0.00 1.95 2.13 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.45 0.00 120 L 7.55 4.54 0.00 1.58 1.65 1.03 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.54 4.76 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.64 0.97 0.00 0.00 122 E 8.80 4.03 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 123 K 8.52 4.49 0.00 1.98 1.84 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.13 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.62 1.41 7.81 124 R 7.80 4.15 0.00 1.76 1.91 0.00 3.25 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 125 S 7.84 4.28 0.00 4.03 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 H 8.24 5.12 0.00 3.08 3.12 0.00 5.69 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 H 8.68 4.67 0.00 3.02 3.19 0.00 5.72 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 H 8.27 4.51 0.00 3.09 3.14 0.00 5.98 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00